CID 269260

Phenylmethanesulfonohydrazide

Structural Information

Molecular Formula

C₇H₁₀N₂O₂S

SMILES

C1=CC=C(C=C1)CS(=O)(=O)NN

InChI

InChI=1S/C7H10N2O2S/c8-9-12(10,11)6-7-4-2-1-3-5-7/h1-5,9H,6,8H2

InChIKey

XBCFRZRVCDUSGX-UHFFFAOYSA-N

Compound name

phenylmethanesulfonohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 435
Patents: 186.0463 Da
Monoisotopic Mass: 0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	187.053576	135.8
[M+Na]+	209.035518	143.2
[M-H]-	185.039024	139.1
[M+NH4]+	204.080123	154.9
[M+K]+	225.009458	140.1
[M+H-H2O]+	169.043560	129.7
[M+HCOO]-	231.044501	156.1
[M+CH3COO]-	245.060151	181.0
[M+Na-2H]-	207.020966	142.1
[M]+	186.04575142	135.4
[M]-	186.04684858	135.4

Literature stripe

literature stripe

Patent stripe

patents stripe